| CAS Number | 2044901-34-8 |
| Catalog Number | AG01BV41 |
| Chemical Name | 4-(2,2-difluorocyclopropoxy)benzoic acid |
| IUPAC Name | 4-(2,2-difluorocyclopropyl)oxybenzoic acid |
| InChI | InChI=1S/C10H8F2O3/c11-10(12)5-8(10)15-7-3-1-6(2-4-7)9(13)14/h1-4,8H,5H2,(H,13,14) |
| InChI Key | SKMMNFWHMXBWRZ-UHFFFAOYSA-N |
| MDL Number | MFCD30476248 |
| Molecular Formula | C10H8F2O3 |
| Molecular Weight | 214.1655 |
| SMILES | OC(C1=CC=C(OC2C(F)(F)C2)C=C1)=O |
| Synonyms | 4-(2,2-difluorocyclopropoxy)benzoic acid,
2044901-34-8,
|
| Complexity | 259 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.168g/mol |
| Monoisotopic Mass | 214.044g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number